Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 8/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 7/20 | 0.42 |
| ▸ | CYP11B2 | P19099 | 6/20 | 0.41 |
| ▸ | HMOX2 | P30519 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.37 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | QPCT | Q16769 | 1/20 | 0.36 |
| ▸ | CYP4Z1 | Q86W10 | 1/20 | 0.36 |
| ▸ | QPCTL | Q9NXS2 | 1/20 | 0.36 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL7738278 | 0.88 | SLC6A4 (0.40) | CYP11B1CYP19A1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL7740290 | 0.75 | CYP11B1 (0.49) | CYP11B1CYP19A1CYP11B2TBXAS1CYP1A2 | |
| SCHEMBL7737867 | 0.71 | CYP19A1 (0.56) | CYP11B1CYP19A1CYP11B2TBXAS1CYP2D6 | |
| SCHEMBL9371997 | 0.68 | CYP11B1 (0.53) | CYP11B1CYP19A1CYP11B2HMOX2TBXAS1 | |
| SCHEMBL6299490 | 0.67 | CYP19A1 (0.61) | CYP11B1CYP19A1 | |
| SCHEMBL6301112 | 0.67 | CYP19A1 (0.61) | CYP11B1CYP19A1 | |
| SCHEMBL7731119 | 0.66 | CYP11B1 (0.59) | CYP11B1CYP19A1CYP11B2TBXAS1CYP1A2 | |
| SCHEMBL570582 | 0.64 | CYP11B1 (1.00) | CYP11B1CYP19A1CYP11B2TBXAS1CYP1A2 | |
| SCHEMBL7740341 | 0.63 | CYP11B1 (0.57) | CYP11B1CYP19A1CYP11B2TBXAS1CYP1A2 | |
| SCHEMBL2729830 | 0.63 | CYP11B1 (1.00) | CYP11B1CYP19A1CYP11B2TBXAS1CYP1A2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-RE37781-E1 | VIRICIDES, PROTEASE INHIBITOR | DUPONT PHARMACEUTICALS COMPANY | 2002-07-02 | — | — | US | disclosed |